CID 165890063

En300-39708218

Structural Information

Molecular Formula
C9H17NO
SMILES
CN1CC[C@@]2([C@H]1CCC2)CO
InChI
InChI=1S/C9H17NO/c1-10-6-5-9(7-11)4-2-3-8(9)10/h8,11H,2-7H2,1H3/t8-,9-/m1/s1
InChIKey
MCUXKVWSZCABHI-RKDXNWHRSA-N
Compound name
[(3aS,6aR)-1-methyl-2,3,4,5,6,6a-hexahydrocyclopenta[b]pyrrol-3a-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 136.7
[M+Na]+ 178.12023 143.7
[M-H]- 154.12373 138.1
[M+NH4]+ 173.16483 162.2
[M+K]+ 194.09417 141.7
[M+H-H2O]+ 138.12827 131.8
[M+HCOO]- 200.12921 155.6
[M+CH3COO]- 214.14486 173.0
[M+Na-2H]- 176.10568 139.8
[M]+ 155.13046 133.2
[M]- 155.13156 133.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.