CID 45075373

1289388-20-0

Structural Information

Molecular Formula
C13H19NO
SMILES
CC1=CC=CC=C1COC2CCCNC2
InChI
InChI=1S/C13H19NO/c1-11-5-2-3-6-12(11)10-15-13-7-4-8-14-9-13/h2-3,5-6,13-14H,4,7-10H2,1H3
InChIKey
NVDNJKGJBMROPH-UHFFFAOYSA-N
Compound name
3-[(2-methylphenyl)methoxy]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 148.0
[M+Na]+ 228.13589 152.4
[M-H]- 204.13939 150.8
[M+NH4]+ 223.18049 164.6
[M+K]+ 244.10983 148.9
[M+H-H2O]+ 188.14393 140.2
[M+HCOO]- 250.14487 165.8
[M+CH3COO]- 264.16052 183.2
[M+Na-2H]- 226.12134 152.4
[M]+ 205.14612 142.8
[M]- 205.14722 142.9
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.