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]+ 262.216536 163.5
[M+Na]+ 284.198478 169.8
[M-H]- 260.201984 167.5
[M+NH4]+ 279.243083 183.7
[M+K]+ 300.172418 166.3
[M+H-H2O]+ 244.206520 157.1
[M+HCOO]- 306.207461 183.6
[M+CH3COO]- 320.223111 203.4
[M+Na-2H]- 282.183926 168.0
[M]+ 261.20871142 164.3
[M]- 261.20980858 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.