CID 208345

32038-41-8

Structural Information

Molecular Formula
C17H27NO
SMILES
CCCCNC1CC2=C(C=C(C=C2)OC)C(C1)(C)C
InChI
InChI=1S/C17H27NO/c1-5-6-9-18-14-10-13-7-8-15(19-4)11-16(13)17(2,3)12-14/h7-8,11,14,18H,5-6,9-10,12H2,1-4H3
InChIKey
FTAORKKFEKSNTI-UHFFFAOYSA-N
Compound name
N-butyl-6-methoxy-4,4-dimethyl-2,3-dihydro-1H-naphthalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.20926 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.21654 163.5
[M+Na]+ 284.19848 169.8
[M-H]- 260.20198 167.5
[M+NH4]+ 279.24308 183.7
[M+K]+ 300.17242 166.3
[M+H-H2O]+ 244.20652 157.1
[M+HCOO]- 306.20746 183.6
[M+CH3COO]- 320.22311 203.4
[M+Na-2H]- 282.18393 168.0
[M]+ 261.20871 164.3
[M]- 261.20981 164.3
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.