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GNPS Library Spectrum CCMSLIB00013581293

Ions:

a 1⁺ 2⁺ 3⁺
b 1⁺ 2⁺ 3⁺
c 1⁺ 2⁺ 3⁺
x 1⁺ 2⁺ 3⁺
y 1⁺ 2⁺ 3⁺
z 1⁺ 2⁺ 3⁺
[Deselect All]

Neutral Loss:

NH₃ (*)
H₂O (o)
H₃PO₄ (p)

Immonium ions
Reporter ions

Mass Type:
Mono Avg

Mass Tol:
Th ppm

Peak Assignment:
Most Intense
Nearest Match
Peak Detect

Peak Labels:
Ionm/z
None

Width: 935

Height: 600

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Click and drag in the plot to zoom X: Y: Enable tooltip Plot mass error

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Th

Latest Library Spectrum Information

Spectrum ID	CCMSLIB00013581293
Compound Name	R-N6-succinyladenosine
PI	Axel_Marchal
Data Collector	TE_MLS
CAS Number	132154-36-0
Original Submitter	jzemlin
Most Recent Revisor	jzemlin
Library Quality	Gold Spectrum
Smiles	O[C@H]1[C@H](N2C=3C(N=C2)=C(N[C@H](CC(O)=O)C(O)=O)N=CN3)O[C@H](CO)[C@H]1O
InChI	InChI=1S/C14H17N5O8/c20-2-6-9(23)10(24)13(27-6)19-4-17-8-11(15-3-16-12(8)19)18-5(14(25)26)1-7(21)22/h3-6,9-10,13,20,23-24H,1-2H2,(H,21,22)(H,25,26)(H,15,16,18)/t5-,6-,9-,10-,13-/m1/s1
Structure
NPAtlas/MIBiG
External Chemical Resources	View All External Resources
Metabolomics Spectrum Resolver	mzspec:GNPS:WINE-DB-ORBITRAP:accession:CCMSLIB00013581293
Precursor M/Z	384.114
Exact Mass	383.31
Charge	1
Adduct	M+H
Ion Source	ESI
Instrument	Orbitrap
Ion Mode	Positive
Spectrum Provenance Input File	Download Provenance File
Download Library Spectrum Peaks	Download Spectrum Peaks
Library Membership	WINE-DB-ORBITRAP
SPLASH Key	null-null-null-null
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Spectrum Tags

	Type	Description	Database	URL	URL	Remove Tag
Datasets ID Hits 1 ~ 0 out of 0 Go to Select columns
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Spectrum Annotation History

	Comment	Compound Name	PI	Adduct	Data_Collector	Precursor_MZ	user_id	Pubmed ID	Time
Spectrum Annotations and Comments Hits 1 ~ 1 out of 1 Go to Select columns
checked only
1	Comment	R-N6-succinyladenosine	Axel_Marchal	M+H	TE_MLS	384.114	jzemlin	N/A	2025-03-07 09:30:43.0

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