CID 3057779

74195-75-8

Structural Information

Molecular Formula

C₈H₁₅N

SMILES

CC1CC2CCCC2N1

InChI

InChI=1S/C8H15N/c1-6-5-7-3-2-4-8(7)9-6/h6-9H,2-5H2,1H3

InChIKey

PCLLYADXFXPXMU-UHFFFAOYSA-N

Compound name

2-methyl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 58
Patents: 125.12045 Da
Monoisotopic Mass: 1.5
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]+	126.12773	129.7
[M+Na]+	148.10967	136.2
[M-H]-	124.11317	130.9
[M+NH4]+	143.15427	154.4
[M+K]+	164.08361	134.0
[M+H-H2O]+	108.11771	124.4
[M+HCOO]-	170.11865	148.7
[M+CH3COO]-	184.13430	142.6
[M+Na-2H]-	146.09512	132.1
[M]+	125.11990	124.1
[M]-	125.12100	124.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe