CID 13313618

91595-79-8

Structural Information

Molecular Formula
C9H17NO
SMILES
CC1CCN(CC1)CC2CO2
InChI
InChI=1S/C9H17NO/c1-8-2-4-10(5-3-8)6-9-7-11-9/h8-9H,2-7H2,1H3
InChIKey
ZXECTFQQKBDZQX-UHFFFAOYSA-N
Compound name
4-methyl-1-(oxiran-2-ylmethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 138.0
[M+Na]+ 178.12023 145.4
[M-H]- 154.12373 144.2
[M+NH4]+ 173.16483 151.6
[M+K]+ 194.09417 144.8
[M+H-H2O]+ 138.12827 130.4
[M+HCOO]- 200.12921 156.7
[M+CH3COO]- 214.14486 180.2
[M+Na-2H]- 176.10568 143.6
[M]+ 155.13046 137.7
[M]- 155.13156 137.7
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

patents stripe