CID 59137

101931-30-0

Structural Information

Molecular Formula
C14H17NO
SMILES
CC(C)OC1=CC=C(C2=CC=CC=C21)CN
InChI
InChI=1S/C14H17NO/c1-10(2)16-14-8-7-11(9-15)12-5-3-4-6-13(12)14/h3-8,10H,9,15H2,1-2H3
InChIKey
HNJQUQJPAIGREO-UHFFFAOYSA-N
Compound name
(4-propan-2-yloxynaphthalen-1-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.13101 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.13829 148.8
[M+Na]+ 238.12023 156.3
[M-H]- 214.12373 153.0
[M+NH4]+ 233.16483 168.3
[M+K]+ 254.09417 153.0
[M+H-H2O]+ 198.12827 142.4
[M+HCOO]- 260.12921 171.3
[M+CH3COO]- 274.14486 193.2
[M+Na-2H]- 236.10568 154.3
[M]+ 215.13046 149.2
[M]- 215.13156 149.2
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.