CID 3310247

73627-18-6

Structural Information

Molecular Formula

C₈H₁₂N₂

SMILES

CC1C2=CC=CN2CCN1

InChI

InChI=1S/C8H12N2/c1-7-8-3-2-5-10(8)6-4-9-7/h2-3,5,7,9H,4,6H2,1H3

InChIKey

JPXCPEMQVOKKFV-UHFFFAOYSA-N

Compound name

1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 71
Patents: 136.10005 Da
Monoisotopic Mass: 0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	137.10733	128.6
[M+Na]+	159.08927	140.3
[M+NH4]+	154.13387	137.9
[M+K]+	175.06321	135.5
[M-H]-	135.09277	129.7
[M+Na-2H]-	157.07472	133.6
[M]+	136.09950	130.4
[M]-	136.10060	130.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe